Input 01-propagators.06-aetrs.inp

Commits > Commit 4eed2c655b9f478fca43a397c5feb863f7436add > Run eb_intel-2022a_omp_impi

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060684240205384e+01 -1.060684240205380e+01 5.300000000000000e-14 -3.730349362740526e-14 PASS
Energy [step 20] -1.060634982716840e+01 -1.060634982716840e+01 5.300000000000000e-13 3.552713678800501e-15 PASS
Multipoles [step 0] 1.394962270695466e-15 2.282730401188460e-15 4.670000000000000e-15 -8.877681304929943e-16 PASS
Multipoles [step 20] -1.265513823243646e-01 -1.265513823243620e-01 6.330000000000000e-15 -2.581268532253489e-15 PASS
Forces [step 0] 8.537491810748987e-02 8.537491810749601e-02 8.799999999999999e-15 -6.133982211053990e-15 PASS
Forces [step 20] 7.966699321588289e-02 7.966699321588180e-02 4.000000000000000e-14 1.082467449009528e-15 PASS
Compare to other inputs